N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C12H10N4O2 — CID 1252016

IUPACN-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NCc1ccco1)c1cnn2cccnc12
InChIInChI=1S/C12H10N4O2/c17-12(14-7-9-3-1-6-18-9)10-8-15-16-5-2-4-13-11(10)16/h1-6,8H,7H2,(H,14,17)
InChIKeyOXPLSZQIKJRTCN-UHFFFAOYSA-N
MW242.24 g/mol
LogP1.25
Rot. Bonds3

About N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 1252016) has the molecular formula C12H10N4O2 and a molecular weight of 242.24 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID1252016
Molecular FormulaC12H10N4O2
Molecular Weight242.24 g/mol
Exact Mass242.08
IUPAC NameN-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NCc1ccco1)c1cnn2cccnc12
InChIInChI=1S/C12H10N4O2/c17-12(14-7-9-3-1-6-18-9)10-8-15-16-5-2-4-13-11(10)16/h1-6,8H,7H2,(H,14,17)
InChIKeyOXPLSZQIKJRTCN-UHFFFAOYSA-N
XLogP1.25
TPSA72.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.24
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(furan-2-ylmethylcarbamoyl)-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19414658
6-(diethylaminomethyl)-N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56756831
6-hydroxy-2-[(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)methyl]-1-benzofuran-7-carboxylic acid
CID 164866752
4-methyl-2-[(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)methyl]-1-benzofuran-7-carboxylic acid
CID 164866538
methyl 2-[5-bromo-2-[(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)methyl]-1-benzofuran-7-yl]acetate
CID 164866770
N-[[2-(phenoxymethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 39977011
N-(1H-imidazo[4,5-b]pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 136535072
methyl 2-[5-methyl-2-[(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)methyl]-1-benzofuran-7-yl]acetate
CID 164866387
N-(furan-2-ylmethyl)-2,3,7-triazatricyclo[7.5.0.02,6]tetradeca-1(9),3,5,7-tetraene-5-carboxamide
CID 20919312
1-[(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)methyl]cyclopropane-1-carboxylic acid
CID 146136440
N-(furan-2-ylmethyl)-3-imidazo[1,2-b]pyridazin-3-ylbenzamide
CID 90480126
2,2,2-trifluoroethyl 5-fluoro-2-[(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)methyl]-1-benzofuran-7-carboxylate
CID 164866505

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 1252016) is N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is O=C(NCc1ccco1)c1cnn2cccnc12.
What is the InChIKey of N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is OXPLSZQIKJRTCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4O2/c17-12(14-7-9-3-1-6-18-9)10-8-15-16-5-2-4-13-11(10)16/h1-6,8H,7H2,(H,14,17).
What are the key properties of N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 242.24 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 1252016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).